7-[(2S,3R,4S,5S,6R)-6-(hydroxymethyl)-3,4,5-tris(oxidanyl)oxan-2-yl]oxy-3-methyl-4,8-bis(oxidanyl)naphthalene-1,2-dione

Systemtic Name: 7-[(2S,3R,4S,5S,6R)-6-(hydroxymethyl)-3,4,5-tris(oxidanyl)oxan-2-yl]oxy-3-methyl-4,8-bis(oxidanyl)naphthalene-1,2-dione Openeye Name: 4,8-dihydroxy-3-methyl-7-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxy-naphthalene-1,2-dione CAS Name: 4,8-dihydroxy-3-methyl-7-[[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)-2-oxanyl]oxy]naphthalene-1,2-dione IUPAC Name: 4,8-dihydroxy-3-methyl-7-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxynaphthalene-1,2-dione Traditional Name: 4,8-dihydroxy-3-methyl-7-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-methylol-tetrahydropyran-2-yl]oxy-1,2-naphthoquinone Formula: C17H18O10 MolecularWeight: 382.31882

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C(=C(C=C2)OC3C(C(C(C(O3)CO)O)O)O)O)C(=O)C1=O)O

Isomeric SMILES

CC1=C(C2=C(C(=C(C=C2)O[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)CO)O)O)O)O)C(=O)C1=O)O

InChI

InChI=1S/C17H18O10/c1-5-10(19)6-2-3-7(12(21)9(6)14(23)11(5)20)26-17-16(25)15(24)13(22)8(4-18)27-17/h2-3,8,13,15-19,21-22,24-25H,4H2,1H3/t8-,13-,15+,16-,17-/m1/s1